N-[bis(azanyl)methylidene]-1-(1-naphthalen-1-yl-4-oxidanyl-pentan-3-yl)imidazole-4-carboxamide; ethanoic acid

Systemtic Name: N-[bis(azanyl)methylidene]-1-(1-naphthalen-1-yl-4-oxidanyl-pentan-3-yl)imidazole-4-carboxamide; ethanoic acid Openeye Name: acetic acid; N-(diaminomethylene)-1-[2-hydroxy-1-[2-(1-naphthyl)ethyl]propyl]imidazole-4-carboxamide CAS Name: acetic acid; N-(diaminomethylidene)-1-[4-hydroxy-1-(1-naphthalenyl)pentan-3-yl]-4-imidazolecarboxamide IUPAC Name: acetic acid; N-(diaminomethylidene)-1-(4-hydroxy-1-naphthalen-1-ylpentan-3-yl)imidazole-4-carboxamide Traditional Name: acetic acid; N-(diaminomethylene)-1-[2-hydroxy-1-[2-(1-naphthyl)ethyl]propyl]imidazole-4-carboxamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC2=CC=CC=C21)N3C=C(N=C3)C(=O)N=C(N)N)O.CC(=O)O

Isomeric SMILES

CC(C(CCC1=CC=CC2=CC=CC=C21)N3C=C(N=C3)C(=O)N=C(N)N)O.CC(=O)O

InChI

InChI=1S/C20H23N5O2.C2H4O2/c1-13(26)18(25-11-17(23-12-25)19(27)24-20(21)22)10-9-15-7-4-6-14-5-2-3-8-16(14)15;1-2(3)4/h2-8,11-13,18,26H,9-10H2,1H3,(H4,21,22,24,27);1H3,(H,3,4)